(Q115971798)

English

(2R)-2-amino-3-[[(1S,3S)-3,7-dihydroxy-5-(2-hydroxyethyl)-2,2,4,6-tetramethyl-1,3-dihydroinden-1-yl]sulfanyl]propanoic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

illudalane sesquiterpenoid

1 reference

based on heuristic

inferred from SMILES

mass

369.160993964 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R)-2-amino-3-[[(1R,3R)-3,7-dihydroxy-5-(2-hydroxyethyl)-2,2,4,6-tetramethyl-1,3-dihydroinden-1-yl]sulfanyl]propanoic acid

1 reference

based on heuristic

inferred from InChI

(2R)-2-amino-3-[[(1R,3S)-3,7-dihydroxy-5-(2-hydroxyethyl)-2,2,4,6-tetramethyl-1,3-dihydroinden-1-yl]sulfanyl]propanoic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₈H₂₇NO₅S

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canonical SMILES

O=C(O)C(N)CSC1C2=C(O)C(=C(C(=C2C(O)C1(C)C)C)CCO)C

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isomeric SMILES

Cc1c(O)c2c(c(C)c1CCO)[C@H](O)C(C)(C)[C@@H]2SC[C@H](N)C(=O)O

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found in taxon

Granulobasidium vellereum

1 reference

stated in

Cytotoxic Illudane Sesquiterpenes from the FungusGranulobasidium vellereum(Ellis and Cragin) Jülich

Identifiers

InChI

InChI=1S/C18H27NO5S/c1-8-10(5-6-20)9(2)14(21)13-12(8)15(22)18(3,4)16(13)25-7-11(19)17(23)24/h11,15-16,20-22H,5-7,19H2,1-4H3,(H,23,24)/t11-,15-,16+/m0/s1

0 references

InChIKey

JHOMHDIYMKJFGR-KNXALSJPSA-N

0 references

2 references

3 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

JHOMHDIYMKJFGR-KNXALSJPSA-N

1 reference

(Q115971798)

(2R)-2-amino-3-[[(1S,3S)-3,7-dihydroxy-5-(2-hydroxyethyl)-2,2,4,6-tetramethyl-1,3-dihydroinden-1-yl]sulfanyl]propanoic acid

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Identifiers

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