ID: 40846
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 40847
SMILES:CC12OC1C(=O)c1c(O)cc(CCCC)cc1OC(CCC=C(C)C)(C)C2C=CC(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -13.815
InChIKey:ZEZIYEZTQJKYIF-UHFFFAOYSA-N
ID: 40848
SMILES:C1C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C2C(C)(O2)CCC=C(C)CCC(C(=C)C)CC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.825
CB1 binding score: -15.369
InChIKey:ZOPHPSAQHYRNSA-UHFFFAOYSA-N
ID: 40849
SMILES:C1C2(C(C)C)OC2CCC2(C)C1c1c(cc(CCCCCO)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.694
InChIKey:IVTKMHYZKADVDD-UHFFFAOYSA-N
ID: 40850
SMILES:C(CCCC)=CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.368
InChIKey:SGVWDAXIHIJRHI-UHFFFAOYSA-N
ID: 40851
SMILES:c1(CCCCC)cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 40852
SMILES:C=C(C1CC23CCC4C(C)=C(OC)C(=O)CC4(C)C2C(c2c(O)cc(CCC)cc2OC1)O3)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -15.427
InChIKey:YTNXSKQTEZRDQF-UHFFFAOYSA-N
ID: 40853
SMILES:C(=CCC=C(C)C)(C=CCC(C)=CCc1c(O)c(C)cc(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.339
InChIKey:YJIJQYKRECIVSO-UHFFFAOYSA-N
ID: 40854
SMILES:CC(C)C1C(c2c(O)cc(CCCCC)cc2O)CC(C)(O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.62
InChIKey:KYPDWLIHTDTEAC-UHFFFAOYSA-N
ID: 40855
SMILES:CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(OC)c2C(=O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.733
InChIKey:MUPBMAOFEXJBJS-UHFFFAOYSA-N
ID: 40856
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.136
InChIKey:NFKLWWOCMIMUDL-UHFFFAOYSA-N
ID: 40857
SMILES:C(CCc1cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.854
InChIKey:ZGNBDHDIIXUCDX-UHFFFAOYSA-N
ID: 40858
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 40859
SMILES:C(CCCC)c1cc(O)c(CC=C(C)CCC=C(C(=O)O)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.723
InChIKey:WJFILTHPTPTQEA-UHFFFAOYSA-N
ID: 40860
SMILES:Oc1cc2c(c(C)c1)OC(C(C)=CCCC(CC)C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.21
InChIKey:FMTIQRCPLBWXFJ-UHFFFAOYSA-N
ID: 40861
SMILES:c1(O)cc(CCCCC)ccc1C=C1C(C(C)C)CCC(C)=CCCC1=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -12.791
InChIKey:SPPYNKLGTBJMGQ-UHFFFAOYSA-N
ID: 40862
SMILES:c1(O)cc(CCCCC)cc2c1C1OC(C)(CC(O)C=C(C)C)C1CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.62
InChIKey:NEMDNDVVAJTUDC-UHFFFAOYSA-N
ID: 40863
SMILES:C(C=C(C)CCC=C(C)C)(=O)c1c(O)c(C2C=C(C)CCC2C(C)C)c(O)c(CC=C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -13.896
InChIKey:DFSQNJGTQGBBRO-UHFFFAOYSA-N
ID: 40864
SMILES:O=C(C=CCCCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.56
CB1 binding score: -16.15
InChIKey:WZBUFAMTULMNEF-UHFFFAOYSA-N
ID: 40865
SMILES:C(CC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 40866
SMILES:C(CCCCCCCCCC(NCCc1ccccc1)=O)Cc1cc2c3c(c1)OC(C)(C)C3CC=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 515.782
CB1 binding score: -16.926
InChIKey:PANYHWRRYBJMFX-UHFFFAOYSA-N