ID: 53509
SMILES:C1(C(c2c(O)cccc2)C)CC(C(C)C)C(c2c(O)cc(CCCCC)cc2C#CCCC(=O)OCCCC)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.792
CB1 binding score: -16.903
InChIKey:CZGYEEIJJFZHIN-UHFFFAOYSA-N
ID: 53510
SMILES:CCCC(CC(CCCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.847
InChIKey:XOANPVDWSJXTDE-UHFFFAOYSA-N
ID: 53511
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(CO)=C1C2=O)C=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -14.646
InChIKey:GAXIEFUKYCEWHN-UHFFFAOYSA-N
ID: 53512
SMILES:C1(C)c2c(cc(CCC)cc2O)OC(C(C)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -16.655
InChIKey:ZWQASZFLZUBAJV-UHFFFAOYSA-N
ID: 53513
SMILES:CCCCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(=C)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -19.131
InChIKey:FWJYXILFWARSSI-UHFFFAOYSA-N
ID: 53514
SMILES:C(C=C(C)C)C(C(O)(C)CCC1OC1(C)C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.562
InChIKey:QZWDNMCXSIPUDF-UHFFFAOYSA-N
ID: 53515
SMILES:CC1(C)C2CCC(C(O)=O)=CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.531
InChIKey:MNPOCGUOPCCMCZ-UHFFFAOYSA-N
ID: 53516
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)CC2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.089
InChIKey:KGUNGFGWLPOOLQ-UHFFFAOYSA-N
ID: 53517
SMILES:CC(C)C1C(c2c(O)cc(CCCC)cc2O)OC(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -16.791
InChIKey:HFCULKBJCOYMPC-UHFFFAOYSA-N
ID: 53518
SMILES:c1(C(=CCCO)C)cc2c(c(O)c1CC=C(C)C)OC(C)(C)C1C2C=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.848
InChIKey:ADWBLQKIBBNCOZ-UHFFFAOYSA-N
ID: 53519
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 53520
SMILES:CC(C)=CCCC(=CCc1c(O)cc(C(C)CCCCCC)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -16.113
InChIKey:OFGYSDZNAMKZDI-UHFFFAOYSA-N
ID: 53521
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 53522
SMILES:C1(C)=CC2C3(C(=O)OC(C)(C)C2CCC3C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -16.529
InChIKey:QDCGTKJFWHHRSF-UHFFFAOYSA-N
ID: 53523
SMILES:C(=C(CCC=C(C)CCC=C(C)C)C)C(=O)c1c2c(cc3c1CC(C)OC3=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.749
CB1 binding score: -14.249
InChIKey:SMCDFKIXQLVBKM-UHFFFAOYSA-N
ID: 53524
SMILES:CC1(C)C(O)C2(c3c(cc(CCCCCOCCSC)cc3OC)OC2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.696
CB1 binding score: -15.397
InChIKey:BDISURXXQRZVQV-UHFFFAOYSA-N
ID: 53525
SMILES:C(CC1(C)Oc2c(cc(OC)cc2C)C=C1)=C(C)CC=CC(OC(=O)C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -17.916
InChIKey:NTAILFBNOFBRGX-UHFFFAOYSA-N
ID: 53526
SMILES:C1C(C(C)C)C(c2cc(CCCCC)ccc2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 284.487
CB1 binding score: -16.438
InChIKey:FZKDNZVILILJLN-UHFFFAOYSA-N
ID: 53527
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C1(O)C(C(C)C)CCC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.6
InChIKey:ICLJRQZHBFJMTR-UHFFFAOYSA-N
ID: 53528
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 53529
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.334
InChIKey:LMTQDQLMOBKYNY-UHFFFAOYSA-N