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Manzamine D structure
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Manzamine D

TL;DR: Manzamine D (CAS 116477-23-7) is a chemical compound with molecular formula C36H48N4O and molecular weight 552.3828 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(1S,2R,4R,5Z,12R,13S,16Z)-25-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-11,22-diazapentacyclo[11.11.2.12,22.02,12.04,11]heptacosa-5,16,25-trien-13-ol

Also Known As: Manzamine D, (1S,2R,4R,5Z,12R,13S,16Z)-25-((1R)-2,3,4,9-tetrahydro-1H-pyrido(3,4-b)indol-1-yl)-11,22-diazapentacyclo(11.11.2.12,22.02,12.04,11)heptacosa-5,16,25-trien-13-ol, (1S,2R,4R,5Z,12R,13S,16Z)-25-(2,3,4,9-tetrahydro-1H-pyrido(3,4-b)indol-1-yl)-11,22-diazapentacyclo(11.11.2.12,22.02,12.04,11)heptacosa-5,16,25-trien-13-ol, (1S,2R,4R,5Z,12R,13S,16Z)-25-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-11,22-diazapentacyclo[11.11.2.12,22.02,12.04,11]heptacosa-5,16,25-trien-13-ol, (1S,2R,4R,5Z,12R,13S,16Z)-25-[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]-11,22-diazapentacyclo[11.11.2.12,22.02,12.04,11]heptacosa-5,16,25-trien-13-ol

CAS Number
116477-23-7
Molecular Formula
C36H48N4O
Molecular Weight
552.3828 g/mol
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Technical Specifications

Molecular FormulaC36H48N4O
Molecular Weight552.3828 g/mol
XLogP4.9
Topological Polar Surface Area (TPSA)54.5 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass552.3828 Da
Heavy Atoms41
Complexity1050.0
SMILESC1CCN2CC[C@H]3C(=C[C@@](CC/C=C\C1)([C@H]4[C@]3(C2)C[C@H]/5N4CCCC/C=C5)O)C6C7=C(CCN6)C8=CC=CC=C8N7
InChIKeyXKUVHUCZHJQMJW-VHSSNGTLSA-N

Chemical Property Profile of Manzamine D

XLogP
4.9
TPSA (Topological Polar Surface Area)
54.5
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
41
Complexity
1050.0
Exact Mass
552.3828
Monoisotopic Mass
552.3828
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Manzamine D

The XLogP value of 4.9 indicates that Manzamine D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, Manzamine D exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Manzamine D has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Manzamine D?

The CAS number of Manzamine D is 116477-23-7.

What is the molecular formula of Manzamine D?

The molecular formula of Manzamine D is C36H48N4O.

What is the molecular weight of Manzamine D?

The molecular weight of Manzamine D is 552.3828 g/mol.

Where can I buy Manzamine D?

You can request a quote for Manzamine D directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Manzamine D?

Yes, CoreyChem provides custom synthesis services for Manzamine D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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