Isoharringtonine

1-O-[(2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl] 4-O-methyl (2R,3S)-2,3-dihydroxy-2-(3-methylbutyl)butanedioate

CAS: 26833-86-3

Molecular Formula	`C28H37NO9`
Molecular Weight	531.6 g/mol
LogP	1.3
Topological Polar Surface Area	124.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	10
Rotatable Bonds	10
Exact Mass	531.2468
Heavy Atoms	38
Complexity	939.0

Chemical Identifiers

CAS Number	26833-86-3
SMILES	`CC(C)CCC(C(C(=O)OC)O)(C(=O)OC1C2C3=CC4=C(C=C3CCN5C2(CCC5)C=C1OC)OCO4)O`
InChIKey	`CAOHZEUEVKYHPF-XWHOPEMDSA-N`

📖 Product Overview

Isoharringtonine (CAS: 26833-86-3) is a chemical compound with molecular formula C28H37NO9 and molecular weight 531.6 g/mol. Its IUPAC systematic name is 1-O-[(2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl] 4-O-methyl (2R,3S)-2,3-dihydroxy-2-(3-methylbutyl)butanedioate. LogP 1.3 Topological Polar Surface Area 124.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 10 Rotatable Bonds 10 Exact Mass 531.2468 Heavy Atoms 38 Complexity 939.0 InChI Key: CAOHZEUEVKYHPF-XWHOPEMDSA-N. SMILES: CC(C)CCC(C(C(=O)OC)O)(C(=O)OC1C2C3=CC4=C(C=C3CCN5C2(CCC5)C=C1OC)OCO4)O.

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