Structure

Garlicin

CAS
138540-99-5
Catalog Number
ACM138540995
Category
Other Products
Molecular Weight
172.178480 [g/mol]
Molecular Formula
C8H12O4

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Specification

Synonyms
AGN-PC-003XKK, AKOS006311320, AC-20243, 4,7-dihydroxy-3a,4,5,6,7,7a-hexahydro-3H-2-benzofuran-1-one, 138540-99-5
IUPAC Name
4,7-dihydroxy-3a,4,5,6,7,7a-hexahydro-3H-2-benzofuran-1-one
Canonical SMILES
C1CC(C2C(C1O)COC2=O)O
InChI Key
GZFFFMYJURFCNK-UHFFFAOYSA-N
Exact Mass
172.07400
Hazard Statements
Xn
H-Bond Acceptor
4
H-Bond Donor
2
Safety Description
S16-S26-S37/39
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