ID: 89398
SMILES:C(=CCc1c(OC(=O)C)cc(CCCCC)cc1O)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.767
InChIKey:OGCCABVUOZBTQV-UHFFFAOYSA-N
ID: 89399
SMILES:C1(C)=CCC(C(=C)C)CC1c1c(O)cc(C(C)C(C(CC)C)OC(CC)=O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.526
InChIKey:WLTDWHSGFUZFAH-UHFFFAOYSA-N
ID: 89400
SMILES:C(C(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 89401
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 89402
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C(=O)OC(=O)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -13.114
InChIKey:MDRNCSKQZVCDMT-UHFFFAOYSA-N
ID: 89403
SMILES:CC(OC(=O)C)(C1Oc2cc(O)c(C(OC)=O)c(O)c2CC1C(C)=C)CCCC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.529
CB1 binding score: -16.743
InChIKey:DEPBQEPERPZHCK-UHFFFAOYSA-N
ID: 89404
SMILES:C12(C)Oc3cc(CCCCC)cc(O)c3C3C1C(C(C)(C)C3)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.254
InChIKey:QWVOEMGBZLDEHL-UHFFFAOYSA-N
ID: 89405
SMILES:O(c1cc2c(cc1C)OC(C)(C)C1CCC(C)=CC21)CCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.075
InChIKey:BMJHYFBUSOGBCI-UHFFFAOYSA-N
ID: 89406
SMILES:Oc1c(C(=O)C(C)CC)c(OC)c(O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.541
InChIKey:WKELVKCXXZSWAF-UHFFFAOYSA-N
ID: 89407
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(CCC=C(C)C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.845
InChIKey:QWOPKGWJXRLGGI-UHFFFAOYSA-N
ID: 89408
SMILES:Oc1cc(C)c(CCC(C)C2CCC(C)=CC2c2c(O)cc(CC)cc2O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.348
InChIKey:OYMMDPRQHRKOCM-UHFFFAOYSA-N
ID: 89409
SMILES:C1(c2c(O)c(C=O)c(CCCCC)c(I)c2O)C(C(=C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.375
CB1 binding score: -14.625
InChIKey:IZMYBIWBHXCOPW-UHFFFAOYSA-N
ID: 89410
SMILES:C1(O)C(=C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.941
InChIKey:YRXPGUPXVCGYGF-UHFFFAOYSA-N
ID: 89411
SMILES:Oc1cc(C)cc(O)c1CC1C(C)(C)Oc2cc(CCCCC)c(C=O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -15.639
InChIKey:APKATKPIWQHWRB-UHFFFAOYSA-N
ID: 89412
SMILES:C1(C)=C(C)C(O)C(c2cc(OC)cc(CCCCCC)c2)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.537
InChIKey:DPVDPEMDSHUUEQ-UHFFFAOYSA-N
ID: 89413
SMILES:C1(C)CC(c2c(O)cc(CCCCC)cc2O)C(C(CCC=C(C)C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.803
InChIKey:CRLXIKJOFJXVTF-UHFFFAOYSA-N
ID: 89414
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 89415
SMILES:C12(C)CC3C(C(C)=C)(CC1O)OC1C(O)C(O)C(Oc4cc(O)cc(CCCC)c4)OC3C1CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.621
CB1 binding score: -15.434
InChIKey:HGZXSPUIHYQWGR-UHFFFAOYSA-N
ID: 89416
SMILES:Oc1c(O)c(CC=C(C)CCC=C(C)C)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 396.571
CB1 binding score: -15.399
InChIKey:FAILPIKOHAVSRP-UHFFFAOYSA-N
ID: 89417
SMILES:c1(O)ccc(CCCCCC)c2c1C1C(CC=C(C)C1(C)C=CC(=O)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.058
InChIKey:WHYMNKKRVZYIEK-UHFFFAOYSA-N
ID: 89418
SMILES:C1C(O)C(C)=CC(c2c(O)cc(CCCCC)cc2O)C1(O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.783
InChIKey:YMCYMKRIRYBQBH-UHFFFAOYSA-N