ID: 56848
SMILES:C1=C(C)CCC(C(CCC=C(C)C)(O)C)C1c1c(O)cc(CCc2ccccc2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -15.684
InChIKey:JODGOYMAHFKZKT-UHFFFAOYSA-N
ID: 56849
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2OC)C=C2C(C(C)(C)CCC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -14.937
InChIKey:YXPNTPWIIZHLJX-UHFFFAOYSA-N
ID: 56850
SMILES:C12C(C)=CCCC1(C)Cc1c(c(C=O)c(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.084
InChIKey:XUZRSWIYNTUJSE-UHFFFAOYSA-N
ID: 56851
SMILES:C12C(C)=C(CC1)C(CCC=C(C)C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.825
InChIKey:ROXYTIXPSXMPAV-UHFFFAOYSA-N
ID: 56852
SMILES:CCCCCc1c(C(=O)O)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 56853
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 56854
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(=C)C)CCC(C)(O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.141
InChIKey:BDFKQWLDHZHBNB-UHFFFAOYSA-N
ID: 56855
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 56856
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1CC(C(=C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.655
InChIKey:RQXYOTLEEDTWOM-UHFFFAOYSA-N
ID: 56857
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)CC21)CC(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.63
CB1 binding score: -14.239
InChIKey:DFAFRVNZXHMGEH-UHFFFAOYSA-N
ID: 56858
SMILES:C(C)CCCc1cc2c(c(O)c1)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.07
InChIKey:PWOSUXRZLMNZAZ-UHFFFAOYSA-N
ID: 56859
SMILES:C(Cc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -19.67
InChIKey:QXOBJECFIJLBPW-UHFFFAOYSA-N
ID: 56860
SMILES:C1C(C(=C)C)C(c2cc(CO)c(O)cc2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -13.755
InChIKey:FSVDXKLLYBBMSG-UHFFFAOYSA-N
ID: 56861
SMILES:Cc1cc(OC)c(CCC(=O)C)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.562
InChIKey:JBSGYUZUOSEAHQ-UHFFFAOYSA-N
ID: 56862
SMILES:C1C(C(=C)C)C(c2c(O)ccc(O)c2)C=C(C(=O)O)C1C=CC=CC(C(C)C(C)CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -14.977
InChIKey:FCXOOPVCZCWLDP-UHFFFAOYSA-N
ID: 56863
SMILES:CC1(C)C(CC(=O)C(C)=O)C2(c3c(cc(CCCCC)cc3O)O1)C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -13.018
InChIKey:ZROWGGIBKASFDZ-UHFFFAOYSA-N
ID: 56864
SMILES:c1(O)c(C(O)=O)c(CCCCC)cc(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 56865
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(c2ccccc2)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.585
CB1 binding score: -16.025
InChIKey:BUNSIIUWLXXDSY-UHFFFAOYSA-N
ID: 56866
SMILES:C(c1cc2c(cc1)C(C)(C)Oc1c-2cc(CCCCC)cc1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -16.655
InChIKey:DOVFGSDHSBCTSS-UHFFFAOYSA-N
ID: 56867
SMILES:C(CCCC)Cc1cc2c(c(O)c1)CC1(O)C3(CC(C(=C)C)C1C)OC32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: Not available
InChIKey:KLLGZERFXLWBCG-UHFFFAOYSA-N
ID: 56868
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC12)C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -15.578
InChIKey:BUPMQSHJRPTIPM-UHFFFAOYSA-N