ID: 84631
SMILES:CC(=CCc1c(-c2c(O)cc(CCCCC)cc2O)c(O)c2c(c1O)OC(C)(C)C(O)C2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -14.189
InChIKey:SXJVYDCLTVKOMN-UHFFFAOYSA-N
ID: 84632
SMILES:CCCCc1cc2c(c(O)c1)C1C(CCC(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.792
InChIKey:UGRLMQVLYLFVDE-UHFFFAOYSA-N
ID: 84633
SMILES:C(=O)c1cc(CC)cc(C2C=C(C)CCC2C(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.4
CB1 binding score: -14.749
InChIKey:ASRGGCQNTWKPQH-UHFFFAOYSA-N
ID: 84634
SMILES:C1(C)(O)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.522
InChIKey:XTHXQACBFDXOKH-UHFFFAOYSA-N
ID: 84635
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(C)(O)C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.334
InChIKey:LTJOTHGPJVLRQN-UHFFFAOYSA-N
ID: 84636
SMILES:C1CC(CO)=CC2c3c(O)cc(C(C)O)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.89
InChIKey:SDPYNXURCJUTQU-UHFFFAOYSA-N
ID: 84637
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 84638
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C(O)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.764
InChIKey:FOLRFKWBUIJXNS-UHFFFAOYSA-N
ID: 84639
SMILES:CC1=CCCC(C)=CC(Oc2ccc(CCCC)cc2)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.562
CB1 binding score: -13.776
InChIKey:FHAVLMALOYRSOM-UHFFFAOYSA-N
ID: 84640
SMILES:C=C(C1C(c2c(O)cc(C)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 84641
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1(O)C(C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.853
InChIKey:ZPEJUCGBZQHQMJ-UHFFFAOYSA-N
ID: 84642
SMILES:c1(CCCCC)c(C)cc2c(c1O)C1C(C(C)(C)O2)CC=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.438
InChIKey:QBZAXBVNCNYLFY-UHFFFAOYSA-N
ID: 84643
SMILES:C1(C)C=CC2=C1c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -16.27
InChIKey:XGCKLNKLZFCFRP-UHFFFAOYSA-N
ID: 84644
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)cc(O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.743
InChIKey:LROWJHOWHIPGBZ-UHFFFAOYSA-N
ID: 84645
SMILES:C1C(O)(C)CC2C1C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.386
InChIKey:PQRASKAKLPJGKK-UHFFFAOYSA-N
ID: 84646
SMILES:c1(O)ccc(CCc2cc(O)c3c(c2)OC(C)(C)C2C3C(CCC(C)=C)C(C)(O)C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -14.65
InChIKey:LNJHDRVWNXSYHZ-UHFFFAOYSA-N
ID: 84647
SMILES:C12(C)C(O)c3c(O)cc(CCCCC)cc3OC1(C)C=CC(C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.096
InChIKey:VDJJCQCCGSKKJG-UHFFFAOYSA-N
ID: 84648
SMILES:Oc1c(CCCCC)cc2c(c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.497
InChIKey:MPSLHJUTUUBRHL-UHFFFAOYSA-N
ID: 84649
SMILES:Cc1ccc2c(c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 84650
SMILES:C1C(CO)=CC2c3c(cc(CCCCC)c(C(O)=O)c3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.888
InChIKey:PQLHCGPBCSGLBO-UHFFFAOYSA-N
ID: 84651
SMILES:COc1c(CCCCC)cc(O)c2c1OC1(C)CC2C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.386
InChIKey:STWAADCUKHRRLZ-UHFFFAOYSA-N