ID: 83707
SMILES:O(C1C(O)C(O)C(O)C(CO)O1)CC1=CC(=O)Oc2cc(CCCCC)cc3c2C1CC(C(O)(C)C)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.591
CB1 binding score: -14.282
InChIKey:LHTMUDGHDXHLNA-UHFFFAOYSA-N
ID: 83708
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 83709
SMILES:O(C(C(C)=CC)=O)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -18.611
InChIKey:OSDIKQKOMVSGJD-UHFFFAOYSA-N
ID: 83710
SMILES:C1C2C(CCC1(C)O)C(C)(C)Oc1c2c(O)cc2c1C(O)C(CCC(=O)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -14.742
InChIKey:WRZAQYJZUMVQTH-UHFFFAOYSA-N
ID: 83711
SMILES:C1C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 83712
SMILES:c1(CC=C)c(O)cc(OCCCC)c(C2C(C(C)=C)CC(O)C(C)=C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.027
InChIKey:ABMTYAFHRIZEHL-UHFFFAOYSA-N
ID: 83713
SMILES:CC(CC(O)C=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -16.502
InChIKey:UKEFZNMDYDSUSG-UHFFFAOYSA-N
ID: 83714
SMILES:C1(C(=C)C)CCCC2(C)C(C1c1c(O)cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.042
InChIKey:ZHNFDEXUYTZQMA-UHFFFAOYSA-N
ID: 83715
SMILES:C(c1cc(OC)c(C2C(C(C)=C)CC(=O)C(C)=C2)cc1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -15.644
InChIKey:YNKSXBLIPQIZKD-UHFFFAOYSA-N
ID: 83716
SMILES:c1(O)c(CCCC)cc(O)c(CC=C(C)CCC=C(C)C)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.701
InChIKey:BOQVDBYSHFMSCS-UHFFFAOYSA-N
ID: 83717
SMILES:c1(CCCCCC)cc2c(c(O)c1C(=O)O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.44
InChIKey:BVBRJJOJHMNEEX-UHFFFAOYSA-N
ID: 83718
SMILES:C(CCCCc1cc2c(c(OS(=O)(=O)O)c1)C=CC(C)(C)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.441
CB1 binding score: -16.858
InChIKey:LAZRGZJOUXUPQZ-UHFFFAOYSA-N
ID: 83719
SMILES:O(c1c2c(cc(CCCCC)c1)C=CC(C)(CCC=C(C)C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.7
InChIKey:CXDMDOGDTCMJBD-UHFFFAOYSA-N
ID: 83720
SMILES:c1(C)cc(O)cc2c1CC(C(C1=CCC(C)(C)O1)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.578
InChIKey:XJXLXGWYHXWCHK-UHFFFAOYSA-N
ID: 83721
SMILES:C12C(C)(C)Oc3c(c(OC)cc(CCCC)c3O1)CC1C(C)(O1)CCCC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.492
InChIKey:UMXZLZUOCQXEAH-UHFFFAOYSA-N
ID: 83722
SMILES:C1(C)=CCCC2(C)CC3=C(C(C)(C)Oc4cc(CCCCC)cc(OC(C)=O)c4C3)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -17.657
InChIKey:LGPDTBAEZOTKDG-UHFFFAOYSA-N
ID: 83723
SMILES:C(Cc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.655
InChIKey:SZHRAJIVTRNORX-UHFFFAOYSA-N
ID: 83724
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 83725
SMILES:Cc1cc2c(cc1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 83726
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(C(=O)C(CC)C)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -15.369
InChIKey:FXAJFWYDDBKMEG-UHFFFAOYSA-N
ID: 83727
SMILES:CC(OO)=CCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.367
InChIKey:LKFJKPQPHOIYOL-UHFFFAOYSA-N