ID: 42631
SMILES:O(C(C)=O)c1c(CC=C(C)C)c(O)cc(C(O)CCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -14.161
InChIKey:ROJWITMIHSOUDZ-UHFFFAOYSA-N
ID: 42632
SMILES:C(C)CCCCCCc1cc2c(c(O)c1C(OC)=O)C#CC(=C)C1CCC(C)CC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: Not available
InChIKey:IDJANSFUFWNNNP-UHFFFAOYSA-N
ID: 42633
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCC)c2)C2C1CCC(C)=CCCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.305
InChIKey:OHHTZGGMUJZBOI-UHFFFAOYSA-N
ID: 42634
SMILES:C1C(c2c(O)cc(CCCCCO)cc2O)(C)CCC(C(C)(C)O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: Not available
InChIKey:AUMIONWVXMFOAP-UHFFFAOYSA-N
ID: 42635
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 42636
SMILES:COCCc1cc2c(cc1)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -14.703
InChIKey:DZOCDPYOUYLTQR-UHFFFAOYSA-N
ID: 42637
SMILES:c12c3c(O)c4c(c1OC3(C(CCC(C(C)C)C)=C)C)OC(C)(C)C1CCC(C)(O2)C41
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.548
InChIKey:NTLKNYHPTSPJBO-UHFFFAOYSA-N
ID: 42638
SMILES:C(c1c2cc(c(C)c1)OC(C)(C)C1CCC(C)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -12.429
InChIKey:TWXYOBZSEOXKHY-UHFFFAOYSA-N
ID: 42639
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(CCC=C(C)C)O2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.141
InChIKey:QZSPREBWAWUEGM-UHFFFAOYSA-N
ID: 42640
SMILES:c1c(CCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 42641
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2CC=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.842
InChIKey:ZVZRSLDINWLUFX-UHFFFAOYSA-N
ID: 42642
SMILES:O1C2(C=CC(C)(O)C)OC(CCc3c(O)cc(C)cc3O)(C)C1CCC2(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -12.543
InChIKey:WXPUZAZXEWSIIN-UHFFFAOYSA-N
ID: 42643
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)C1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.956
InChIKey:KIVHRBVVEPFQFA-UHFFFAOYSA-N
ID: 42644
SMILES:C(CCc1cc2c(c(OCCC)c1)C(=O)C1(O2)OC(C)(C)C(=O)CC1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -16.631
InChIKey:LVUDQVFZIIOVIF-UHFFFAOYSA-N
ID: 42645
SMILES:C1Cc2c(c3c(cc2C)OC(C)(C)C3)C=C1C(CCC(O)(C)C)C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -14.611
InChIKey:OPZVKZQGTCHYEF-UHFFFAOYSA-N
ID: 42646
SMILES:C(CC=C(CC=CC(OC(=O)C)(C)C)C)C(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -14.124
InChIKey:WYLNYGVAVUDZAK-UHFFFAOYSA-N
ID: 42647
SMILES:C1CC(O)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)c(C=O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.175
InChIKey:FXPUOIUDCYUANI-UHFFFAOYSA-N
ID: 42648
SMILES:C1CC2(C)OC1c1c(cc(CCCCC)cc1OC)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.646
InChIKey:ZIYHOMYXEWHWRN-UHFFFAOYSA-N
ID: 42649
SMILES:C(CC=C(C)C)C1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 42650
SMILES:c1(CCCCC)c(O)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.178
InChIKey:QGOQBAPWMFNGTE-UHFFFAOYSA-N
ID: 42651
SMILES:c1(C)c(OC)cc2cc1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.771
InChIKey:HBNSYMXRYLIWRS-UHFFFAOYSA-N