ISOARBORINOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H50O
Molecular Weight	426.7174
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)[C@@H]1CC[C@H]2[C@@]1(C)CC[C@@]3(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C

InChI

InChIKey=VWYANPOOORUCFJ-MBVQSDBHSA-N

InChI=1S/C30H50O/c1-19(2)20-9-12-24-28(20,6)17-18-29(7)22-10-11-23-26(3,4)25(31)14-15-27(23,5)21(22)13-16-30(24,29)8/h13,19-20,22-25,31H,9-12,14-18H2,1-8H3/t20-,22+,23-,24-,25-,27+,28-,29-,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H50O
Molecular Weight	426.7174
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:28:21 GMT 2025` Edited by `admin` on `Wed Apr 02 10:28:21 GMT 2025`
Record UNII	74JE8XL7LQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOARBORINOL

Common Name

English

(+)-Isoarborinol

Preferred Name

English

(3.BETA.,21.BETA.)-13,17-DIMETHYL-A'-NEO-26,28-DINORGAMMACER-9(11)-EN-3-OL

Systematic Name

English

ARBORINOL B

Systematic Name

English

D:C-FRIEDO-B':A'-NEO-8.BETA.,13.BETA.,14.ALPHA.,17.BETA.,18.ALPHA.,21.ALPHA.H-GAMMACER-9(11)-EN-3.BETA.-OL

Systematic Name

English

(3S,3aS,5aS,5bS,7aR,9S,11aS,13aR,13bS)-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysen-9-ol

Systematic Name

English

SORGHUMOL

Systematic Name

English

Code System Code Type Description

PUBCHEM

12305182