ID: 34525
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 34526
SMILES:O(C)c1cc(OC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.39
InChIKey:SCELBGHLBZKGMN-UHFFFAOYSA-N
ID: 34527
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 34528
SMILES:c1c(O)cc(CCCC)c(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.19
InChIKey:JLDQAMHHOUWHJX-UHFFFAOYSA-N
ID: 34529
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 34530
SMILES:CC1=CC=C(C(CCC=C(C)C)C)C(c2c(O)c(OC(C)=O)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -17.594
InChIKey:IWUGCFAEYRXIJJ-UHFFFAOYSA-N
ID: 34531
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1=C=CC(C)(O)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.462
InChIKey:VPGFWLBTMLRYMC-UHFFFAOYSA-N
ID: 34532
SMILES:c1c(O)c2c(cc1)OC(C)(C)C1C2CC2(C)CCC(O)C(C(O)=O)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -13.93
InChIKey:CVCJKAYYEHXVCM-UHFFFAOYSA-N
ID: 34533
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 34534
SMILES:C(CCCC)c1cc2c(cc1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 34535
SMILES:C(C1CC2C(C)(Oc3cc(CCCC)c(C(O)=O)c(O)c32)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.365
InChIKey:ZJRYRQLGCJNKPE-UHFFFAOYSA-N
ID: 34536
SMILES:CC1(C(=O)O)C2CC=C(C)CC2c2c(cc(C)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -14.967
InChIKey:IUTQWIGDZQJJLC-UHFFFAOYSA-N
ID: 34537
SMILES:c12c(cc(CCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 34538
SMILES:O(c1cc2c(c(C)c1)CC1C(CCC=C(C)C)(C)C2C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.535
CB1 binding score: -15.967
InChIKey:CZHHXRLJMFZQOY-UHFFFAOYSA-N
ID: 34539
SMILES:C1CC2(C(COCC(CO)CNC)=CC3c4c(cc(C)cc4O)OC23C)CC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 427.585
CB1 binding score: Not available
InChIKey:TTZQEVCWFKHFPS-UHFFFAOYSA-N
ID: 34540
SMILES:c1c(CCCCC)cc2c(c1O)C1CC(C)(OCC1C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -17.638
InChIKey:FBGFXBCBTKGNMK-UHFFFAOYSA-N
ID: 34541
SMILES:CC1=CC2C(C(C)(C)Oc3c(C(=O)CC(C)C)c(O)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.385
InChIKey:KCKFCLWTUCSIQS-UHFFFAOYSA-N
ID: 34542
SMILES:OCC(c1c(O)c2c(c(C=O)c1O)C1C(C(C)(C)O2)CCC(C)=C1)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.526
InChIKey:KMRSDCLFQJGUOP-UHFFFAOYSA-N
ID: 34543
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c(c(O)ccc1C=C)C2OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.29
InChIKey:OBDHPHDIJKCVCX-UHFFFAOYSA-N
ID: 34544
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 34545
SMILES:C12C(=C(C)C(=O)C1)CC1(C)CCC3C(C)(C)Oc4c(c(O)cc(CCCC)c4)C3C1(O)C(O)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.688
CB1 binding score: -15.717
InChIKey:UUECJDOMDQAJAO-UHFFFAOYSA-N