ID: 137404
SMILES:C(CCC(=O)C)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.334
InChIKey:KAWLFZLGIPXNTP-UHFFFAOYSA-N
ID: 137405
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)c(O)c1)CCC(C)(O)CC(OC(C)=O)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.644
CB1 binding score: -16.676
InChIKey:OGDXXAXTOSKMAQ-UHFFFAOYSA-N
ID: 137406
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 137407
SMILES:c1(C2C=C(C)CCC2C(C)=C)c(O)cc(C)c(-c2c(O)cc(CCCCC)cc2O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -14.084
InChIKey:IWPZEAJDGFGJFM-UHFFFAOYSA-N
ID: 137408
SMILES:C1CC(C)C2(C)C3(C)C1(CC2)C12OC1C1C(C(C)(C)Oc4cc(CCCCC)cc(O)c14)C3OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -13.344
InChIKey:GOQZQQJOOZLMKM-UHFFFAOYSA-N
ID: 137409
SMILES:C12CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC(C)(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.066
InChIKey:CEYWTDSGPLJDRN-UHFFFAOYSA-N
ID: 137410
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 137411
SMILES:c1(O)cc2c(cc1C(=O)C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.546
InChIKey:WAFSFKUTMHJRLV-UHFFFAOYSA-N
ID: 137412
SMILES:c12c(OC)cc(OC)cc1C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.977
InChIKey:QETKVXOWHGJKNX-UHFFFAOYSA-N
ID: 137413
SMILES:O1c2c(c(O)cc(CCCCC)c2)CC1C(=C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.846
InChIKey:NBVPTAKVRPHONU-UHFFFAOYSA-N
ID: 137414
SMILES:c1(=O)c2c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.435
InChIKey:JLMCDNCKOQNXAE-UHFFFAOYSA-N
ID: 137415
SMILES:C(c1c(O)cc(C)c(O)c1)C=C(C)CCC=C(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.545
InChIKey:ZEZZPXAGNBATNY-UHFFFAOYSA-N
ID: 137416
SMILES:C1(=O)c2c(O)cc(CCCCC)cc2OC(C)(C)C12CC=C(C(=O)O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -13.286
InChIKey:DPELGONPXQFFHN-UHFFFAOYSA-N
ID: 137417
SMILES:C1(C(C)(C)O)CCc2c(O)cc(CCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -17.645
InChIKey:PHKJLPBDTGLSDC-UHFFFAOYSA-N
ID: 137418
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(ccc(CCCCC)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.248
InChIKey:ULSCPFQNHAPIEH-UHFFFAOYSA-N
ID: 137419
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 137420
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 137421
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(C(C)=C)CC=C2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -13.702
InChIKey:FJHYLSKVZFSTSE-UHFFFAOYSA-N
ID: 137422
SMILES:CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.919
InChIKey:DJWDPAFDAAGMNO-UHFFFAOYSA-N
ID: 137423
SMILES:c12c(cc(CCCCC)cc1OC)Oc1c(ccc(CC=C)c1C(=O)OCC(C)(O)CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.655
CB1 binding score: -16.099
InChIKey:PZYFOSJTGMDYJJ-UHFFFAOYSA-N
ID: 137424
SMILES:C1C2C(O)(CC(C)(C)CC2=O)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -13.522
InChIKey:IKAXFPVUJLOGBL-UHFFFAOYSA-N