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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H22O4
Molecular Weight 278.3435
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HIRSUTIC ACID METHYL ESTER

SMILES

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

InChI

InChIKey=LUHQGEITPSERET-FNATZYGXSA-N
InChI=1S/C16H22O4/c1-8-11(17)12-16(20-12)6-9-5-14(2,13(18)19-4)7-10(9)15(8,16)3/h9-12,17H,1,5-7H2,2-4H3/t9-,10-,11-,12-,14+,15+,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H22O4
Molecular Weight 278.3435
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:52:57 GMT 2023
Edited
by admin
on Sat Dec 16 09:52:57 GMT 2023
Record UNII
QHZ1A4KPHB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HIRSUTIC ACID METHYL ESTER
Common Name English
1H-CYCLOPENTA(A)PENTALENE-2-CARBOXYLIC ACID, 6.BETA.,6A.BETA.-EPOXY-2,3,3A.ALPHA.,3B,4,5,6,6A,7,7A.ALPHA.-DECAHYDRO-5.BETA.-HYDROXY-2.BETA.,3B.BETA.-DIMETHYL-4-METHYLENE-, METHYL ESTER, (+)-
Systematic Name English
HIRSUTIC ACID C METHYL ESTER [MI]
Common Name English
Code System Code Type Description
FDA UNII
QHZ1A4KPHB
Created by admin on Sat Dec 16 09:52:57 GMT 2023 , Edited by admin on Sat Dec 16 09:52:57 GMT 2023
PRIMARY
PUBCHEM
11471445
Created by admin on Sat Dec 16 09:52:57 GMT 2023 , Edited by admin on Sat Dec 16 09:52:57 GMT 2023
PRIMARY
CAS
3650-16-6
Created by admin on Sat Dec 16 09:52:57 GMT 2023 , Edited by admin on Sat Dec 16 09:52:57 GMT 2023
PRIMARY
MERCK INDEX
m6024
Created by admin on Sat Dec 16 09:52:57 GMT 2023 , Edited by admin on Sat Dec 16 09:52:57 GMT 2023
PRIMARY Merck Index