ID: 16612
SMILES:C(CCC=C(C)C)(C)=CCc1cc(OC(=O)C)c(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -18.803
InChIKey:PEAVXEHUMHXIHB-UHFFFAOYSA-N
ID: 16613
SMILES:C12(C)C(C=C(C)CC1)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.254
InChIKey:HNZKDPUEAFFVOB-UHFFFAOYSA-N
ID: 16614
SMILES:C1(C)(c2c(OC(=O)C)cc(CCCCC)cc2O)CCC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.94
InChIKey:MQNNSUAFSIBSHT-UHFFFAOYSA-N
ID: 16615
SMILES:C1CC2C3C(c4c(O)c(C(=O)O)c(CCCCC)cc4O)OC(C)(C)C3CCC(O)(C)C2OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.593
CB1 binding score: -15.01
InChIKey:MBQQOVYXYNALPQ-UHFFFAOYSA-N
ID: 16616
SMILES:C(CCC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(COC(C(C)=CC)=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -18.422
InChIKey:WVLLWHZMDJTZEM-UHFFFAOYSA-N
ID: 16617
SMILES:C1C(O)C2C(C)(C)CCCC2(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.734
InChIKey:LHSCDTAYLHZPAC-UHFFFAOYSA-N
ID: 16618
SMILES:c1(CC=C(CC(O)CC(=C)C)C)c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.502
InChIKey:BTSQZQFDNDDUGT-UHFFFAOYSA-N
ID: 16619
SMILES:Oc1c(C2C(C(C)=C)CC(O)C(=C)C2)cc(CCCCC)c(C(=O)OC(C)=O)c1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -12.884
InChIKey:BWAKQKYZORNPRL-UHFFFAOYSA-N
ID: 16620
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(O)cc(O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.204
InChIKey:MCOHBLINZXMLKV-UHFFFAOYSA-N
ID: 16621
SMILES:C(=C(C)CCC=C(CCC=C(C)C)C)Cc1c(O)c2c(cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 464.69
CB1 binding score: -15.336
InChIKey:GALXOBDKIQNZQT-UHFFFAOYSA-N
ID: 16622
SMILES:Oc1cc2c(cc1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 16623
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(O)C1C2(C)CC(O)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -13.668
InChIKey:CGIQUMXWBNMFAA-UHFFFAOYSA-N
ID: 16624
SMILES:CCCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 16625
SMILES:c1(C=CCCCCC)cc(O)c(C2C=C(C)CCC2C(=C)C)c(OC(=O)CCC)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.415
InChIKey:SPNSVRVUDRXCSU-UHFFFAOYSA-N
ID: 16626
SMILES:c1(CC(O)C)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -18.987
InChIKey:RDPMPRFPOLSURU-UHFFFAOYSA-N
ID: 16627
SMILES:OC1(C)CCC(C(O)(C)C)C12Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: Not available
InChIKey:NHPKZURRMMGNNO-UHFFFAOYSA-N
ID: 16628
SMILES:CC(C(=O)c1c2c(c(CCCCCC)cc1O)OC(C1=CCCC=C1)CC2)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -15.672
InChIKey:YBIMEXGGEIMDAW-UHFFFAOYSA-N
ID: 16629
SMILES:C1C2C(C)(C)C3C1c1c(cc(CCCCC)cc1O)OC2(C)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.826
InChIKey:YGVKNVZUTUVOOB-UHFFFAOYSA-N
ID: 16630
SMILES:C1(O)=CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3OC(C)(C)C3C(CC(C)=C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.805
InChIKey:UIGJLAYMQRFJAF-UHFFFAOYSA-N
ID: 16631
SMILES:C1(C(C)C)CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.855
InChIKey:VBMSTUJNROPVAW-UHFFFAOYSA-N
ID: 16632
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N