MANILADIOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H50O2
Molecular Weight	442.7168
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC(C)(C)CC[C@]1(C)[C@@H](O)C[C@]3(C)C2=CC[C@]4([H])[C@@]5(C)CC[C@H](O)C(C)(C)[C@]5([H])CC[C@@]34C

InChI

InChIKey=VLRYIIPJIVGFIV-QQSFYHFXSA-N

InChI=1S/C30H50O2/c1-25(2)15-16-27(5)20(17-25)19-9-10-22-28(6)13-12-23(31)26(3,4)21(28)11-14-29(22,7)30(19,8)18-24(27)32/h9,20-24,31-32H,10-18H2,1-8H3/t20-,21-,22+,23-,24-,27-,28-,29+,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H50O2
Molecular Weight	442.7168
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Antitubercular activity of triterpenoids from Asteraceae flowers.	2005 Jan	15635183

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:17:02 UTC 2023` Edited by `admin` on `Fri Dec 15 20:17:02 UTC 2023`
Record UNII	LB0NCS29FD
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

MANILADIOL

Common Name

English

OLEAN-12-ENE-3,16-DIOL, (3.BETA.,16.BETA.)-

Common Name

English

3.BETA.,16.BETA.-DIHYDROXYOLEAN-12-ENE

Common Name

English

OLEAN-12-ENE-3.BETA.,16.BETA.-DIOL

Common Name

English

Code System Code Type Description

CAS

595-17-5