ID: 30703
SMILES:C12C(C)(Oc3c(c(OC)cc(CCCCC)c3)C1O)C(=O)C(O)=C1C(C)(C)C(O)CCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -16.358
InChIKey:IRXSHQSYLREIQQ-UHFFFAOYSA-N
ID: 30704
SMILES:C=C(C1CC(C(=C)C)C(c2cc(CCN(C)C)ccc2O)C=C1C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 339.523
CB1 binding score: -14.196
InChIKey:AIALXDMANRNXIJ-UHFFFAOYSA-N
ID: 30705
SMILES:C1C2C(=CC=CC(C)(C)C)C3C(c4c(cc(CCC(C)(C)O)cc4O)O3)CC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.791
InChIKey:GAJBMCSGWMOONG-UHFFFAOYSA-N
ID: 30706
SMILES:OC1(C)CCC2C(C1=O)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -19.1
InChIKey:TXGFTFSVQKYNOL-UHFFFAOYSA-N
ID: 30707
SMILES:C(CC)CCc1cc2c(cc1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 30708
SMILES:Clc1c(C2(CO)OC(C)(C)C(O)CC2)c(O)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.976
CB1 binding score: -15.863
InChIKey:DUBMWKIUWABWDX-UHFFFAOYSA-N
ID: 30709
SMILES:C1C=C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.404
InChIKey:ARDFFCDCEZCDTJ-UHFFFAOYSA-N
ID: 30710
SMILES:C=C1CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.51
InChIKey:ABUYMDYRFWRXCE-UHFFFAOYSA-N
ID: 30711
SMILES:C1(C2CC(=O)c3c(O)c(C(=O)CCO)c(CCCCC)cc3O2)C2C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -13.604
InChIKey:HFLSRTQNGYIAKK-UHFFFAOYSA-N
ID: 30712
SMILES:ClC1C(C)(C)Oc2c(c(O)cc(CCCCCC)c2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.837
CB1 binding score: -12.994
InChIKey:CWMJXWKJKCTFFE-UHFFFAOYSA-N
ID: 30713
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3OC34OC(=O)C(C)=C3CC2C(O)(C)CCC4)OC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -16.504
InChIKey:NPAVOKCGUSZJQD-UHFFFAOYSA-N
ID: 30714
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 30715
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1(O2)CC=C(C)CC1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.745
InChIKey:FJESZIPYEVVFBE-UHFFFAOYSA-N
ID: 30716
SMILES:c1(OC)c(OC)c(CCc2cc(OC)c(O)c(OC)c2)c(O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.589
CB1 binding score: -16.08
InChIKey:FCDJEPLXSWMFQO-UHFFFAOYSA-N
ID: 30717
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)c1ccc3c(c1C2)CCC(=O)C3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -16.985
InChIKey:RNLBKNFKQIPKTA-UHFFFAOYSA-N
ID: 30718
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 30719
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 30720
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1C[n+]1ccn(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 397.583
CB1 binding score: -16.813
InChIKey:YILWKDZSOOSVKP-UHFFFAOYSA-O
ID: 30721
SMILES:CC(C1CCC2(C)C1C1C(C)(Oc3cc(CCCCN(C)C)cc(O)c31)CC2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 399.619
CB1 binding score: -15.509
InChIKey:XFJNPQKJWJLRRF-UHFFFAOYSA-N
ID: 30722
SMILES:CC1(C)C2=C(c3c(cc(CCCCC)cc3O)OC2O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.861
InChIKey:ICHCSNLVIRGAMF-UHFFFAOYSA-N
ID: 30723
SMILES:C(CCCC)c1cc(O)c(CC2C(O)(C)CCC3C(C)(CCC=C(C)C)OC32)c(C)c1[N+](=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.662
CB1 binding score: -12.806
InChIKey:HKEPFQQPBZFOOJ-UHFFFAOYSA-O