(+)-Genipin

CAS Registry Number®

6902-77-8
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CAS Name

(+)-Genipin

Molecular Formula

C11H14O5

Molecular Mass

226.23

Cite this Page

(+)-Genipin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6902-77-8 (retrieved 2024-04-24) (CAS RN: 6902-77-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    120-121 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H14O5/c1-15-10(13)8-5-16-11(14)9-6(4-12)2-3-7(8)9/h2,5,7,9,11-12,14H,3-4H2,1H3/t7-,9-,11-/m1/s1

InChIKey

InChIKey=AZKVWQKMDGGDSV-BCMRRPTOSA-N

SMILES

C(O)C=1[C@@]2([C@@](C(C(OC)=O)=CO[C@H]2O)(CC1)[H])[H]

Canonical SMILES

O=C(OC)C1=COC(O)C2C(=CCC12)CO

Other Names for this Substance

  • Cyclopenta[c]pyran-4-carboxylic acid, 1,4a,5,7a-tetrahydro-1-hydroxy-7-(hydroxymethyl)-, methyl ester, (1R,4aS,7aS)-
  • Cyclopenta[c]pyran-4-carboxylic acid, 1,4aα,5,7aα-tetrahydro-1-hydroxy-7-(hydroxymethyl)-, methyl ester
  • Genipin
  • Cyclopenta[c]pyran-4-carboxylic acid, 1,4a,5,7a-tetrahydro-1-hydroxy-7-(hydroxymethyl)-, methyl ester, [1R-(1α,4aα,7aα)]-
  • (+)-Genipin

Deleted or Replaced CAS Registry Numbers

1202641-87-9, 1642810-78-3

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