ID: 50527
SMILES:C(C)(C)C1CCC(C)C2C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.059
InChIKey:DFDPTHLLXVCMEU-UHFFFAOYSA-N
ID: 50528
SMILES:C1(C)CC2C(C(C)(C)Oc3c(C)c(Oc4ccc(CCCCC)cc4)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.251
InChIKey:FVAWWHIFXAZSMQ-UHFFFAOYSA-N
ID: 50529
SMILES:C(CCC=C(C)CC)(=CCc1c2c(c([N+](O)=O)cc1)OC(C)(C)C1C2CC(C)=CC1)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.632
CB1 binding score: -16.502
InChIKey:JIEGSFCYIDIZJL-UHFFFAOYSA-N
ID: 50530
SMILES:CC(C)=CCCC1c2c(c(O)cc(CCCCC)c2)C2=C(C(=O)C3=C(C=CC(C)(C)O3)C2=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.586
CB1 binding score: -14.924
InChIKey:HVNPIQKYUDWXSY-UHFFFAOYSA-N
ID: 50531
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 50532
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 50533
SMILES:CCCC1=C(O)C2CCC(C)(C)CC2C2=C1C=CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -12.351
InChIKey:NYJLKWKDJOUNHV-UHFFFAOYSA-N
ID: 50534
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2OC12C=CC(=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.052
InChIKey:ZRYFGCXYWZSBPJ-UHFFFAOYSA-N
ID: 50535
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C(=CCC=C(C)C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.574
InChIKey:GOYFULWRPDJLGJ-UHFFFAOYSA-N
ID: 50536
SMILES:c1(CCCCC)cc2c(c(O)c1C(=O)O)cc(O)c(CC=C(CCC=C(C)C)C)c2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -15.929
InChIKey:PSLQCRIAUACSCN-UHFFFAOYSA-N
ID: 50537
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.792
InChIKey:OVLCNLKQINIQNN-UHFFFAOYSA-N
ID: 50538
SMILES:O=C(O)CCCC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -14.45
InChIKey:LKRZNHSUEFYSRR-UHFFFAOYSA-N
ID: 50539
SMILES:Oc1c(CCCC)c(O)c2c(c1C(=O)C=C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.742
InChIKey:PDTIPXCSJCWGSR-UHFFFAOYSA-N
ID: 50540
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.723
InChIKey:WKFVIMFNRJVSJG-UHFFFAOYSA-N
ID: 50541
SMILES:C(CC(C)C)c1c(O)ccc2c1CC(=O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -15.256
InChIKey:QZCWZPIXOXBTFJ-UHFFFAOYSA-N
ID: 50542
SMILES:O1c2cc(CCCC)cc(O)c2C2C3(C)OC3CC23C(C)CC=C3C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.541
InChIKey:MGIVQLKRSAAJRE-UHFFFAOYSA-N
ID: 50543
SMILES:C(C)CCc1cc(O)c2c(c1)C1CC(=C)CCC21OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.08
InChIKey:RVICIROTKUXLHK-UHFFFAOYSA-N
ID: 50544
SMILES:CC1(C)Oc2c(c(O)cc(CCCC)c2)C2CC(=C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.009
InChIKey:AHNDOCSOZYPQHA-UHFFFAOYSA-N
ID: 50545
SMILES:C12C(CC=C(C)C1O)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 50546
SMILES:c1(CCOC2OC(CO)C(O)C(O)C2O)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.544
CB1 binding score: -17.652
InChIKey:WCZCISZZCJMGPF-UHFFFAOYSA-N
ID: 50547
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N