(3S,5R,6R,7S)-19-methyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol

CAS: 81851-68-5

Molecular Formula	`C19H16O3`
Molecular Weight	292.3 g/mol
LogP	2.6
Topological Polar Surface Area	53.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	0
Exact Mass	292.10995
Heavy Atoms	22
Complexity	452.0

Chemical Identifiers

CAS Number	81851-68-5
SMILES	`CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)C(C(C5C4O5)O)O`
InChIKey	`ZSDQORKDUNMTQA-ZSYWTGECSA-N`

📖 Product Overview

(3S,5R,6R,7S)-19-methyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol (CAS: 81851-68-5) is a chemical compound with molecular formula C19H16O3 and molecular weight 292.3 g/mol. Its IUPAC systematic name is (3S,5R,6R,7S)-19-methyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol. LogP 2.6 Topological Polar Surface Area 53.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 0 Exact Mass 292.10995 Heavy Atoms 22 Complexity 452.0 InChI Key: ZSDQORKDUNMTQA-ZSYWTGECSA-N. SMILES: CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)C(C(C5C4O5)O)O.

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for (3S,5R,6R,7S)-19-methyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol.

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