MACROPHORIN B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H30O5
Molecular Weight	374.4706
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1(C)[C@@H]2CCC(=C)[C@H](C[C@@]34O[C@@H]3[C@H](O)C(CO)=CC4=O)[C@@]2(C)CCC1=O

InChI

InChIKey=ZJZYSAJQOPJREK-MWQHCLGASA-N

InChI=1S/C22H30O5/c1-12-5-6-15-20(2,3)16(24)7-8-21(15,4)14(12)10-22-17(25)9-13(11-23)18(26)19(22)27-22/h9,14-15,18-19,23,26H,1,5-8,10-11H2,2-4H3/t14-,15-,18+,19+,21+,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H30O5
Molecular Weight	374.4706
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:19:00 GMT 2025` Edited by `admin` on `Tue Apr 01 19:19:00 GMT 2025`
Record UNII	5G6Q194375
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

(1R,2R,6R)-6-(((1S,4AR,8AR)-5,5,8A-TRIMETHYL-2-METHYLENE-6-OXO-DECALIN-1-YL)METHYL)-2-HYDROXY-3-(HYDROXYMETHYL)-7-OXABICYCLO(4.1.0)HEPT-3-EN-5-ONE

Preferred Name

English

MACROPHORIN B

Common Name

English

7-OXABICYCLO(4.1.0)HEPT-3-EN-2-ONE, 1-((DECAHYDRO-5,5,8A-TRIMETHYL-2-METHYLENE-6-OXO-1-NAPHTHALENYL)METHYL)-5-HYDROXY-4-(HYDROXYMETHYL)-, (1R-(1.ALPHA.(1S*,4AR*,8AR*),5.BETA.,6.ALPHA.))-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID601099775

Created by admin on Tue Apr 01 19:19:00 GMT 2025 , Edited by admin on Tue Apr 01 19:19:00 GMT 2025

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FDA UNII

5G6Q194375

Created by admin on Tue Apr 01 19:19:00 GMT 2025 , Edited by admin on Tue Apr 01 19:19:00 GMT 2025

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CAS

85764-12-1

Created by admin on Tue Apr 01 19:19:00 GMT 2025 , Edited by admin on Tue Apr 01 19:19:00 GMT 2025

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PUBCHEM

101301308

Created by admin on Tue Apr 01 19:19:00 GMT 2025 , Edited by admin on Tue Apr 01 19:19:00 GMT 2025

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