ID: 32530
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1(C)C(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.727
InChIKey:XTEFLGKMKBMXIK-UHFFFAOYSA-N
ID: 32531
SMILES:CC(CC(=O)OC1c2cc(CCCCC)cc(O)c2C2C(C(OC)C=C2C)C(C)(O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -13.842
InChIKey:FNXIWDWAVYSDFJ-UHFFFAOYSA-N
ID: 32532
SMILES:CC1(O)C2c3c(cc(CCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.479
InChIKey:FCKILBNRTKOFAR-UHFFFAOYSA-N
ID: 32533
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CCC=C(C1=CC(=O)C(C)(C)O1)C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -13.817
InChIKey:PQYBVCFNZQAYGK-UHFFFAOYSA-N
ID: 32534
SMILES:C1C2C(C(C)(Oc3cc(CCCCC)ccc32)CCC(C)=C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -17.042
InChIKey:VFAZTUFBOUXKDU-UHFFFAOYSA-N
ID: 32535
SMILES:C(CCc1cc2c(c(OC)c1)CC1C(C)(O2)CCC1C(C)(C)O)(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.929
InChIKey:CJRKMDKMDUYFEZ-UHFFFAOYSA-N
ID: 32536
SMILES:CC(=CCC(=O)C(=CCCC(C)(O)C1Oc2cc(CCCCC)c(C(=O)O)c(O)c2C1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -13.252
InChIKey:OZNKAVXLNBDYJI-UHFFFAOYSA-N
ID: 32537
SMILES:CC(CC(c1c(O)c2c(cc1CCCCC)OC(C)(C)C(O)C2)CCC(C)=C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.083
InChIKey:OSNDFHSUFSJMPD-UHFFFAOYSA-N
ID: 32538
SMILES:C(c1cc(C(=O)O)c2c(c1)OC(C)(C)C1CCC(C)C(=O)C12)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.065
InChIKey:JIWNXDBJLSLCIO-UHFFFAOYSA-N
ID: 32539
SMILES:C1(C)(C)Oc2c(C(C)=O)c(O)cc(CCCCC)c2C2=C1CC(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -11.402
InChIKey:PXVMCIYFRICKOD-UHFFFAOYSA-N
ID: 32540
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(O)c(C=O)c(O)c2c1OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -15.187
InChIKey:JAORUSIDLORUQY-UHFFFAOYSA-N
ID: 32541
SMILES:c1(CC=C(C)C)c(O)c(C(=O)OC)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -17.629
InChIKey:XEUWUHXAAAQAQY-UHFFFAOYSA-N
ID: 32542
SMILES:CC(=CCC1=CCC2C(=C)C(C(C)C=C(C(C(C)CCCCCCC)OC)COC2=O)C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.711
CB1 binding score: -11.94
InChIKey:KBCIUDJSXKEMNC-UHFFFAOYSA-N
ID: 32543
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCc3ccccc3)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -19.258
InChIKey:DYHMKBLKWFFFSZ-UHFFFAOYSA-N
ID: 32544
SMILES:C12C(CCC1C)c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -15.929
InChIKey:DAEUARIAFOIGDF-UHFFFAOYSA-N
ID: 32545
SMILES:CCC(C)Cc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.015
InChIKey:BXTACWWARRHRLS-UHFFFAOYSA-N
ID: 32546
SMILES:c12c(O)cc(CCCC)cc1OC(C)(C)C1=C2C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.675
InChIKey:XSPWKLGAPIWVGA-UHFFFAOYSA-N
ID: 32547
SMILES:CCOCCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.731
InChIKey:QZHANSXTARKJCG-UHFFFAOYSA-N
ID: 32548
SMILES:O=C(CCC(CC(=O)O)O)Oc1c(CCC)cc(OC)c2c1OC(C)(C)C1CCC(=C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.54
CB1 binding score: -14.015
InChIKey:SGZUDALYGDIWKV-UHFFFAOYSA-N
ID: 32549
SMILES:C1C2C(CC3C(C)(O3)C2)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.318
InChIKey:PSODDCRTTVZHGP-UHFFFAOYSA-N
ID: 32550
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C1C1C(CCC2(O)C)C(=C)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: Not available
InChIKey:DEZVUPYRSXQXAU-UHFFFAOYSA-N