ID: 91981
SMILES:C(CC1(C)CCc2c(O)c(C(=O)O)c(CCCCC)cc2O1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.201
InChIKey:WRDOPLLDCBRWNW-UHFFFAOYSA-N
ID: 91982
SMILES:C(CC=C(C)C)C(C)=CCCC1(C)C(Cc2c(O)cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.334
InChIKey:UBUNTEVCKHEUCQ-UHFFFAOYSA-N
ID: 91983
SMILES:C1(C)=CC2C(CC1O)C(C)(C)Oc1c2c(O)cc(CCCCCO)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.144
InChIKey:LUMWPZHGBZKDBI-UHFFFAOYSA-N
ID: 91984
SMILES:CCCCCc1cc(O)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.296
InChIKey:SBDHCUZETSWOAX-UHFFFAOYSA-N
ID: 91985
SMILES:CC(=CCc1c(OC)cc(C)c(C2C=C(C)CCC2C(=C)C)c1CCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -15.421
InChIKey:BSZUCCDHTAPDCZ-UHFFFAOYSA-N
ID: 91986
SMILES:c12c(O)cc(CCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 91987
SMILES:C(c1c(O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.025
InChIKey:JKRUSNBGPVWHFN-UHFFFAOYSA-N
ID: 91988
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 91989
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: 91990
SMILES:Oc1c(C(=O)C(C)C)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17
InChIKey:WQYRNJBNQPTOAV-UHFFFAOYSA-N
ID: 91991
SMILES:O1c2cc(CCCCC)cc(O)c2C2C3C(C(O)(C)CCC2=C1C)CC=C3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.27
InChIKey:REXRVJNIAOTINP-UHFFFAOYSA-N
ID: 91992
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C=O)C1C2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.988
InChIKey:JQGYTSRSFFFEGB-UHFFFAOYSA-N
ID: 91993
SMILES:O=C1c2c(cc(CCCCC)cc2O)OC(C)(C)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -18.334
InChIKey:HJLDQSFDBVFHQA-UHFFFAOYSA-N
ID: 91994
SMILES:CC(C)=CCCC(C)=CCc1c(O)c(C)cc(OC(=O)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.522
InChIKey:PITQHPHVMREBJR-UHFFFAOYSA-N
ID: 91995
SMILES:c12c(cc(COC(=O)C(C)CC)cc1O)OC(C1(C)CCC(O)C(C)(C)O1)CC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.546
CB1 binding score: -14.413
InChIKey:NRVQYMFDGUECAJ-UHFFFAOYSA-N
ID: 91996
SMILES:O1c2c(c(O)cc(CC)c2)C=CC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.588
InChIKey:JZEQHRTZXSCBRS-UHFFFAOYSA-N
ID: 91997
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 91998
SMILES:C1(=O)CC2C(=CC1C)C(=O)C(C)(C)Oc1c2c(O)cc(CC(Cl)C(C)=C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.891
CB1 binding score: Not available
InChIKey:XYUHFRIKSUNVIN-UHFFFAOYSA-N
ID: 91999
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 92000
SMILES:O(C(=O)C)c1c(CCCCC)ccc2c1OC(C)(C)C1C2CC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.217
InChIKey:VNCWDVCEHXEZOP-UHFFFAOYSA-N
ID: 92001
SMILES:C1(=O)C2=C(C(OCc3ccccc3)=O)OC(c3cc(O)c(C4C=C(C)CCC4C(C)=C)c(O)c3)C3C(C)(C)Oc4c(c(O)cc(C)c4)C(C23)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 704.86
CB1 binding score: -14.925
InChIKey:VERRGDWLPRQZPR-UHFFFAOYSA-N