SIMIARENOL

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

[H][C@@]12CC[C@H](C(C)C)[C@@]1(C)CC[C@]3(C)[C@@]4([H])CC=C5[C@@]([H])(CC[C@H](O)C5(C)C)[C@]4(C)CC[C@@]23C

InChI

InChIKey=XVXPXUMUGATHPD-JMJRLLIOSA-N

InChI=1S/C30H50O/c1-19(2)20-9-12-23-27(20,5)15-17-30(8)24-13-10-21-22(11-14-25(31)26(21,3)4)28(24,6)16-18-29(23,30)7/h10,19-20,22-25,31H,9,11-18H2,1-8H3/t20-,22-,23-,24+,25+,27-,28+,29+,30-/m1/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 `Sat Dec 16 08:32:36 GMT 2023` Edited by `admin` on `Sat Dec 16 08:32:36 GMT 2023`
Record UNII	6OU4M247SJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SIMIARENOL

Common Name

English

D:B-FRIEDO-B':A'-NEOGAMMACER-5-EN-3-OL, (3BETA)-

Common Name

English

.BETA.-SIMIARENOL

Common Name

English

(-)-SIMIARENOL

Common Name

English

E:B-FRIEDOHOP-5-EN-3.BETA.-OL

Common Name

English

ADIAN-5-EN-3.BETA.-OL

Common Name

English

SIMIAREN-3.BETA.-OL

Common Name

English

Code System Code Type Description

PUBCHEM

12442794

Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023

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FDA UNII

6OU4M247SJ

Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023

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CAS

1615-94-7

Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023

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EPA CompTox

DTXSID00167162

Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023

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